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BDBM50174686 1-(1-chloro-5-oxa-2,4,11-triaza-dibenzo[a,d]cyclohepten-8-yl)-3-(4-chloro-3-trifluoromethyl-phenyl)-urea::CHEMBL199886

SMILES: FC(F)(F)c1cc(NC(=O)Nc2ccc3Oc4ncnc(Cl)c4N=Cc3c2)ccc1Cl

InChI Key: InChIKey=RGGIEVPMRLEMRX-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50174686   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Insulin receptor


(Homo sapiens (Human))
BDBM50174686
PNG
(1-(1-chloro-5-oxa-2,4,11-triaza-dibenzo[a,d]cycloh...)
Show SMILES FC(F)(F)c1cc(NC(=O)Nc2ccc3Oc4ncnc(Cl)c4N=Cc3c2)ccc1Cl |c:24|
Show InChI InChI=1S/C19H10Cl2F3N5O2/c20-13-3-1-11(6-12(13)19(22,23)24)29-18(30)28-10-2-4-14-9(5-10)7-25-15-16(21)26-8-27-17(15)31-14/h1-8H,(H2,28,29,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.50E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against IR


Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50174686
PNG
(1-(1-chloro-5-oxa-2,4,11-triaza-dibenzo[a,d]cycloh...)
Show SMILES FC(F)(F)c1cc(NC(=O)Nc2ccc3Oc4ncnc(Cl)c4N=Cc3c2)ccc1Cl |c:24|
Show InChI InChI=1S/C19H10Cl2F3N5O2/c20-13-3-1-11(6-12(13)19(22,23)24)29-18(30)28-10-2-4-14-9(5-10)7-25-15-16(21)26-8-27-17(15)31-14/h1-8H,(H2,28,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.50E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against KDR


Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50174686
PNG
(1-(1-chloro-5-oxa-2,4,11-triaza-dibenzo[a,d]cycloh...)
Show SMILES FC(F)(F)c1cc(NC(=O)Nc2ccc3Oc4ncnc(Cl)c4N=Cc3c2)ccc1Cl |c:24|
Show InChI InChI=1S/C19H10Cl2F3N5O2/c20-13-3-1-11(6-12(13)19(22,23)24)29-18(30)28-10-2-4-14-9(5-10)7-25-15-16(21)26-8-27-17(15)31-14/h1-8H,(H2,28,29,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 450n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against FLT3 kinase in a HTRF assay


Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair